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Information card for entry 2241370
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| Coordinates | 2241370.cif |
|---|---|
| Structure factors | 2241370.hkl |
| Original IUCr paper | HTML |
| Chemical name | (<i>E</i>)-5-Benzyloxy-2-{[(4-nitrophenyl)imino]methyl}phenol |
|---|---|
| Formula | C20 H16 N2 O4 |
| Calculated formula | C20 H16 N2 O4 |
| SMILES | Oc1c(/C=N/c2ccc(N(=O)=O)cc2)ccc(OCc2ccccc2)c1 |
| Title of publication | Crystal structure of (<i>E</i>)-5-benzyloxy-2-{[(4-nitrophenyl)imino]methyl}phenol |
| Authors of publication | Ghichi, Nadir; Benaouida, Mohamed Amine; Benboudiaf, Ali; Merazig, Hocine |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 12 |
| Pages of publication | o1000 - o1001 |
| a | 15.3407 ± 0.0005 Å |
| b | 9.5618 ± 0.0003 Å |
| c | 11.7616 ± 0.0004 Å |
| α | 90° |
| β | 100.615 ± 0.001° |
| γ | 90° |
| Cell volume | 1695.72 ± 0.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0687 |
| Residual factor for significantly intense reflections | 0.0485 |
| Weighted residual factors for significantly intense reflections | 0.1242 |
| Weighted residual factors for all reflections included in the refinement | 0.1464 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181914 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/13. |
2241370.cif 2241370.hkl |
| 170604 | 2015-11-29 | cif/ hkl/ Adding structures of 2241370 via cif-deposit CGI script. |
2241370.cif 2241370.hkl |
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public domain and licensed under the
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.
Users of the data should acknowledge the original authors of the
structural data.